N,N-dimethyl-1-[(4-nitrophenyl)methyl]pyridin-1-ium-2-amine bromide

Systemtic Name: N,N-dimethyl-1-[(4-nitrophenyl)methyl]pyridin-1-ium-2-amine bromide Openeye Name: N,N-dimethyl-1-[(4-nitrophenyl)methyl]pyridin-1-ium-2-amine bromide CAS Name: N,N-dimethyl-1-[(4-nitrophenyl)methyl]-2-pyridin-1-iumamine bromide IUPAC Name: N,N-dimethyl-1-[(4-nitrophenyl)methyl]pyridin-1-ium-2-amine bromide Traditional Name: dimethyl-[1-(4-nitrobenzyl)pyridin-1-ium-2-yl]amine bromide Formula: C14H16BrN3O2 MolecularWeight: 338.19974

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC=[N+]1CC2=CC=C(C=C2)[N+](=O)[O-].[Br-]

Isomeric SMILES

CN(C)C1=CC=CC=[N+]1CC2=CC=C(C=C2)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C14H16N3O2.BrH/c1-15(2)14-5-3-4-10-16(14)11-12-6-8-13(9-7-12)17(18)19;/h3-10H,11H2,1-2H3;1H/q+1;/p-1